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361194-28-7

361194-28-7 structural image
Product Name: 4-(3-bromophenyl)-2,7,7-trimethyl-N-(4-methyl-2-pyridinyl)-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxamide
Formula: C25H26BrN3O2
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COMPUTED DESCRIPTORS

Molecular Weight 480.4 g/mol
XLogP3 4.6
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 3
Exact Mass 479.12084 g/mol
Monoisotopic Mass 479.12084 g/mol
Topological Polar Surface Area 71.1 Ų
Heavy Atom Count 31
Formal Charge 0
Complexity 816
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes